BDBM571412 US11440922, Example 31::ethyl (4E)-4-[3-(4- cyanopyridin-2-yl)prop-2- yn-1-ylidene]-3,3- dimethylpiperidine-1- carboxylate

SMILES CCOC(=O)N1CC\C(=C/C#Cc2cc(ccn2)C#N)C(C)(C)C1

InChI Key InChIKey=GSSIGLHMZBXBRJ-UHFFFAOYSA-N

Data  1 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 571412   

TargetMetabotropic glutamate receptor 5(Human)
Recordati Industria Chimica E Farmacentica

US Patent
LigandPNGBDBM571412(ethyl (4E)-4-[3-(4- cyanopyridin-2-yl)prop-2- yn-1...)
Affinity DataIC50: 13.5nMAssay Description:Cells were seeded into black-walled, clear-bottom, 96-well plates at a density of 80000 cell/well, in RPMI (without Phenol Red, without L-glutamine; ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/19/2022
Entry Details
Go to US Patent

TargetMetabotropic glutamate receptor 5(Human)
Recordati Industria Chimica E Farmacentica

US Patent
LigandPNGBDBM571412(ethyl (4E)-4-[3-(4- cyanopyridin-2-yl)prop-2- yn-1...)
Affinity DataKi:  2.93nMAssay Description:Affinity at transmembrane glutamate metabotropic cloned human mGluR5 receptor was evaluated according to the methods of Anderson (Anderson et al., J ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/19/2022
Entry Details
Go to US Patent